COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK428022
Chemical Name: methyl2-({[2-(4-bromophenyl)quinolin-4-yl]carbonyl}amino)-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCC1CCc2c(C1)sc(c2C(=O)OC)NC(=O)c1cc(nc2c1cccc2)c1ccc(cc1)Br

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Molecular Weight: 549.49
Empirical Formula: C28H25BrN2O3S

Physical State: Dry powder
Available Amount: 2594 mg

Lipinsky:
logP: 9.556
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 96
Number of rings: 5

     

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